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2-[5'-(Benzenesulfonyl)-14'-[(methoxycarbonyl)oxy]-9'-(methoxycarbonyl)-3',7',11',15'-tetramethylhexadeca-2',6',10',15'-tetraenyl]-1-[(methoxycarbonyl)oxy]-4-methoxybenzene
SpectraBase Compound ID 2jXGPxQmitw
InChI InChI=1S/C39H50O11S/c1-26(2)35(49-38(41)47-8)19-16-27(3)21-31(37(40)46-7)22-29(5)24-34(51(43,44)33-13-11-10-12-14-33)23-28(4)15-17-30-25-32(45-6)18-20-36(30)50-39(42)48-9/h10-15,18,20-21,24-25,31,34-35H,1,16-17,19,22-23H2,2-9H3/b27-21+,28-15+,29-24+
InChIKey JSYIQLRHBSSNIH-DLHXBKLGSA-N
Mol Weight 726.9 g/mol
Molecular Formula C39H50O11S
Exact Mass 726.307384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GttFAwRycGI
Name 2-[5'-(Benzenesulfonyl)-14'-[(methoxycarbonyl)oxy]-9'-(methoxycarbonyl)-3',7',11',15'-tetramethylhexadeca-2',6',10',15'-tetraenyl]-1-[(methoxycarbonyl)oxy]-4-methoxybenzene
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Formula C39H50O11S
InChI InChI=1S/C39H50O11S/c1-26(2)35(49-38(41)47-8)19-16-27(3)21-31(37(40)46-7)22-29(5)24-34(51(43,44)33-13-11-10-12-14-33)23-28(4)15-17-30-25-32(45-6)18-20-36(30)50-39(42)48-9/h10-15,18,20-21,24-25,31,34-35H,1,16-17,19,22-23H2,2-9H3/b27-21+,28-15+,29-24+
InChIKey JSYIQLRHBSSNIH-DLHXBKLGSA-N
Molecular Weight 726.878 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(\C=C\(CC(\C=C\(CCC(OC(=O)OC)C(=C)C)C)C(=O)OC)C)C\C(=C\Cc1c(OC(=O)OC)ccc(c1)OC)C
SPLASH splash10-0096-9700000000-6dc8f2a658714076e04a
Source of Spectrum AC-134-77-4
Synonyms Methyl (4E,8E)-2-{(1E)-5-[(methoxycarbonyl)oxy]-2,6-dimethyl-1,6-heptadienyl}-10-{5-methoxy-2-[(methoxycarbonyl)oxy]phenyl}-4,8-dimethyl-6-(phenylsulfonyl)-4,8-decadienoate
Wiley ID 812450